4-[(5-bromanyl-2,3-dimethoxy-phenyl)methylidene]-1-phenyl-pyrazolidine-3,5-dione

Systemtic Name: 4-[(5-bromanyl-2,3-dimethoxy-phenyl)methylidene]-1-phenyl-pyrazolidine-3,5-dione Openeye Name: 4-[(5-bromo-2,3-dimethoxy-phenyl)methylene]-1-phenyl-pyrazolidine-3,5-dione CAS Name: 4-[(5-bromo-2,3-dimethoxyphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione IUPAC Name: 4-[(5-bromo-2,3-dimethoxyphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione Traditional Name: 4-(5-bromo-2,3-dimethoxy-benzylidene)-1-phenyl-pyrazolidine-3,5-quinone Formula: C18H15BrN2O4 MolecularWeight: 403.2267

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)Br)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)Br)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C18H15BrN2O4/c1-24-15-10-12(19)8-11(16(15)25-2)9-14-17(22)20-21(18(14)23)13-6-4-3-5-7-13/h3-10H,1-2H3,(H,20,22)